SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3wqo'

List of Similar Pattern of Amino Acids

Hit pattern: 3D amino acid arrangements similar to known drug binding site
Query pattern: Residues from known binding site for annotated drug that match the hit pattern

(Click on the DrReposER ID to view details on interfaces and similar patterns of amino acids)
(Click on the view link on the last column to view superposed patterns of amino acids)
Filter list by:
DrReposER ID / Desc. Hit
PDBID		 Hit
Macromolecule		 Res.
Matches		 Interface HETATM RMSD Dali
Z-score		 Seq.
Identity (%)		 View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1O86_A_LPRA702_1
(ANGIOTENSIN
CONVERTING ENZYME)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		5 / 12 HIS A  78
HIS A 231
GLU A 260
HIS A 222
HIS A 119
 MN  A1002 (-3.6A)
MN  A1001 (-3.6A)
MN  A1002 ( 4.9A)
MN  A1001 ( 4.9A)
MN  A1002 (-3.4A)
 1.06A 1o86A-3wqoA:
undetectable		 1o86A-3wqoA:
18.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1SV5_A_65BA600_0
(REVERSE
TRANSCRIPTASE)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		5 / 10 LEU A 187
VAL A 118
VAL A 115
PRO A  86
LEU A 142
 None
 1.25A 1sv5A-3wqoA:
undetectable		 1sv5A-3wqoA:
19.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1V7Z_A_CRNA401_1
(CREATININE
AMIDOHYDROLASE)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		4 / 8 GLU A 260
HIS A 222
ASP A 192
HIS A 231
 MN  A1002 ( 4.9A)
MN  A1001 ( 4.9A)
MN  A1001 ( 4.5A)
MN  A1001 (-3.6A)
 0.92A 1v7zA-3wqoA:
undetectable		 1v7zA-3wqoA:
21.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1V7Z_B_CRNB3401_1
(CREATININE
AMIDOHYDROLASE)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		4 / 8 GLU A 260
HIS A 222
ASP A 192
HIS A 231
 MN  A1002 ( 4.9A)
MN  A1001 ( 4.9A)
MN  A1001 ( 4.5A)
MN  A1001 (-3.6A)
 0.93A 1v7zB-3wqoA:
undetectable		 1v7zB-3wqoA:
21.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1V7Z_C_CRNC4401_1
(CREATININE
AMIDOHYDROLASE)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		4 / 8 GLU A 260
HIS A 222
ASP A 192
HIS A 231
 MN  A1002 ( 4.9A)
MN  A1001 ( 4.9A)
MN  A1001 ( 4.5A)
MN  A1001 (-3.6A)
 0.92A 1v7zC-3wqoA:
undetectable		 1v7zC-3wqoA:
21.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1V7Z_D_CRND5401_1
(CREATININE
AMIDOHYDROLASE)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		4 / 8 GLU A 260
HIS A 222
ASP A 192
HIS A 231
 MN  A1002 ( 4.9A)
MN  A1001 ( 4.9A)
MN  A1001 ( 4.5A)
MN  A1001 (-3.6A)
 0.93A 1v7zD-3wqoA:
undetectable		 1v7zD-3wqoA:
21.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1V7Z_E_CRNE6401_1
(CREATININE
AMIDOHYDROLASE)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		4 / 8 GLU A 260
HIS A 222
ASP A 192
HIS A 231
 MN  A1002 ( 4.9A)
MN  A1001 ( 4.9A)
MN  A1001 ( 4.5A)
MN  A1001 (-3.6A)
 0.94A 1v7zE-3wqoA:
undetectable		 1v7zE-3wqoA:
21.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1V7Z_F_CRNF7401_1
(CREATININE
AMIDOHYDROLASE)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		4 / 8 GLU A 260
HIS A 222
ASP A 192
HIS A 231
 MN  A1002 ( 4.9A)
MN  A1001 ( 4.9A)
MN  A1001 ( 4.5A)
MN  A1001 (-3.6A)
 0.92A 1v7zF-3wqoA:
undetectable		 1v7zF-3wqoA:
21.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1Z11_C_8MOC501_0
(CYTOCHROME P450,
FAMILY 2, SUBFAMILY
A, POLYPEPTIDE 6)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		5 / 10 VAL A 118
ILE A 189
GLY A 188
ILE A 182
LEU A 142
 None
 1.12A 1z11C-3wqoA:
undetectable		 1z11C-3wqoA:
19.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ZGY_A_BRLA503_2
(PEROXISOME
PROLIFERATOR
ACTIVATED RECEPTOR
GAMMA)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		4 / 5 ILE A 193
ILE A 217
ILE A 257
LEU A 175
 None
 0.78A 1zgyA-3wqoA:
undetectable		 1zgyA-3wqoA:
22.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2C6N_A_LPRA705_1
(ANGIOTENSIN-CONVERTI
NG ENZYME, SOMATIC
ISOFORM)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		5 / 12 HIS A  78
HIS A 231
GLU A 260
HIS A 222
HIS A 119
 MN  A1002 (-3.6A)
MN  A1001 (-3.6A)
MN  A1002 ( 4.9A)
MN  A1001 ( 4.9A)
MN  A1002 (-3.4A)
 1.08A 2c6nA-3wqoA:
undetectable		 2c6nA-3wqoA:
17.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2C6N_B_LPRB705_1
(ANGIOTENSIN-CONVERTI
NG ENZYME, SOMATIC
ISOFORM)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		5 / 12 HIS A  78
HIS A 231
GLU A 260
HIS A 222
HIS A 119
 MN  A1002 (-3.6A)
MN  A1001 (-3.6A)
MN  A1002 ( 4.9A)
MN  A1001 ( 4.9A)
MN  A1002 (-3.4A)
 1.03A 2c6nB-3wqoA:
undetectable		 2c6nB-3wqoA:
17.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2F8G_B_017B401_1
(POL POLYPROTEIN)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		5 / 12 LEU A 187
ALA A 149
VAL A 116
VAL A  98
ILE A 156
 None
 0.95A 2f8gA-3wqoA:
undetectable		 2f8gA-3wqoA:
18.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2Q0J_B_BEZB500_0
(QUINOLONE SIGNAL
RESPONSE PROTEIN)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		5 / 11 HIS A 119
HIS A 195
HIS A  78
SER A  22
LEU A  24
 MN  A1002 (-3.4A)
MN  A1001 (-3.5A)
MN  A1002 (-3.6A)
None
None
 1.17A 2q0jB-3wqoA:
undetectable		 2q0jB-3wqoA:
19.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2X8Z_A_X8ZA1615_1
(ANGIOTENSIN
CONVERTING ENZYME)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		5 / 11 HIS A  78
HIS A 231
GLU A 260
HIS A 222
HIS A 119
 MN  A1002 (-3.6A)
MN  A1001 (-3.6A)
MN  A1002 ( 4.9A)
MN  A1001 ( 4.9A)
MN  A1002 (-3.4A)
 1.08A 2x8zA-3wqoA:
undetectable		 2x8zA-3wqoA:
19.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2X91_A_LPRA1615_1
(ANGIOTENSIN
CONVERTING ENZYME)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		5 / 12 HIS A  78
HIS A 231
GLU A 260
HIS A 222
HIS A 119
 MN  A1002 (-3.6A)
MN  A1001 (-3.6A)
MN  A1002 ( 4.9A)
MN  A1001 ( 4.9A)
MN  A1002 (-3.4A)
 1.07A 2x91A-3wqoA:
undetectable		 2x91A-3wqoA:
19.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2X91_A_LPRA1615_1
(ANGIOTENSIN
CONVERTING ENZYME)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		5 / 12 HIS A 119
HIS A 231
GLU A 260
HIS A  78
VAL A  49
 MN  A1002 (-3.4A)
MN  A1001 (-3.6A)
MN  A1002 ( 4.9A)
MN  A1002 (-3.6A)
None
 1.14A 2x91A-3wqoA:
undetectable		 2x91A-3wqoA:
19.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ZW9_B_SAMB801_1
(LEUCINE CARBOXYL
METHYLTRANSFERASE 2)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		4 / 8 ILE A 148
ASN A 186
SER A 184
TYR A 152
 None
 1.03A 2zw9B-3wqoA:
undetectable		 2zw9B-3wqoA:
18.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3A6J_A_CRNA303_1
(CREATININE
AMIDOHYDROLASE)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		4 / 8 GLU A 260
HIS A 222
ASP A 192
HIS A 231
 MN  A1002 ( 4.9A)
MN  A1001 ( 4.9A)
MN  A1001 ( 4.5A)
MN  A1001 (-3.6A)
 0.92A 3a6jA-3wqoA:
undetectable		 3a6jA-3wqoA:
21.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3A6J_B_CRNB304_1
(CREATININE
AMIDOHYDROLASE)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		4 / 7 GLU A 260
HIS A 222
ASP A 192
HIS A 231
 MN  A1002 ( 4.9A)
MN  A1001 ( 4.9A)
MN  A1001 ( 4.5A)
MN  A1001 (-3.6A)
 0.93A 3a6jB-3wqoA:
undetectable		 3a6jB-3wqoA:
21.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3A6J_C_CRNC305_1
(CREATININE
AMIDOHYDROLASE)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		4 / 8 GLU A 260
HIS A 222
ASP A 192
HIS A 231
 MN  A1002 ( 4.9A)
MN  A1001 ( 4.9A)
MN  A1001 ( 4.5A)
MN  A1001 (-3.6A)
 0.91A 3a6jC-3wqoA:
undetectable		 3a6jC-3wqoA:
21.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3A6J_E_CRNE306_1
(CREATININE
AMIDOHYDROLASE)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		4 / 8 GLU A 260
HIS A 222
ASP A 192
HIS A 231
 MN  A1002 ( 4.9A)
MN  A1001 ( 4.9A)
MN  A1001 ( 4.5A)
MN  A1001 (-3.6A)
 0.95A 3a6jE-3wqoA:
undetectable		 3a6jE-3wqoA:
21.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3A6J_F_CRNF307_1
(CREATININE
AMIDOHYDROLASE)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		4 / 8 GLU A 260
HIS A 222
ASP A 192
HIS A 231
 MN  A1002 ( 4.9A)
MN  A1001 ( 4.9A)
MN  A1001 ( 4.5A)
MN  A1001 (-3.6A)
 0.90A 3a6jF-3wqoA:
undetectable		 3a6jF-3wqoA:
21.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3BVB_B_017B401_1
(PROTEASE
(RETROPEPSIN))		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		6 / 12 LEU A 135
ASN A 138
GLY A 121
VAL A 179
ILE A 170
ILE A 178
 None
 1.43A 3bvbA-3wqoA:
undetectable		 3bvbA-3wqoA:
19.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ILT_H_TRUH800_1
(GLUTAMATE RECEPTOR 2)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		3 / 3 ILE A 264
SER A  34
SER A  23
 None
 0.49A 3iltH-3wqoA:
undetectable		 3iltH-3wqoA:
20.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3N3I_A_ROCA201_2
(PROTEASE)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		4 / 6 ILE A 156
ILE A 251
GLY A 215
VAL A 256
 None
 0.91A 3n3iA-3wqoA:
undetectable		 3n3iA-3wqoA:
23.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3N8Y_B_SALB900_1
(PROSTAGLANDIN G/H
SYNTHASE 1)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		4 / 5 VAL A 244
LEU A 248
ILE A 257
ALA A 221
 None
 0.76A 3n8yB-3wqoA:
undetectable		 3n8yB-3wqoA:
19.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3OXV_C_478C200_1
(HIV-1 PROTEASE)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		5 / 9 LEU A 187
ALA A 149
VAL A 116
VAL A  98
ILE A 156
 None
 0.98A 3oxvC-3wqoA:
undetectable		 3oxvC-3wqoA:
18.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3OXW_B_017B200_2
(HIV-1 PROTEASE)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		5 / 10 LEU A 187
ALA A 149
VAL A 116
VAL A  98
ILE A 156
 None
 0.97A 3oxwB-3wqoA:
undetectable		 3oxwB-3wqoA:
18.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3OXW_D_017D200_2
(HIV-1 PROTEASE)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		5 / 10 LEU A 187
ALA A 149
VAL A 116
VAL A  98
ILE A 156
 None
 0.96A 3oxwD-3wqoA:
undetectable		 3oxwD-3wqoA:
18.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3OXX_A_DR7A100_1
(HIV-1 PROTEASE)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		5 / 12 LEU A 187
ALA A 149
VAL A 116
VAL A  98
ILE A 156
 None
 0.93A 3oxxA-3wqoA:
undetectable		 3oxxA-3wqoA:
18.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3TJ7_A_ACTA604_0
(GBAA_1210 PROTEIN)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		4 / 6 GLY A  20
VAL A 256
HIS A 218
SER A 258
 None
 1.07A 3tj7A-3wqoA:
undetectable
3tj7B-3wqoA:
undetectable		 3tj7A-3wqoA:
20.53
3tj7B-3wqoA:
20.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3TJ7_C_ACTC606_0
(GBAA_1210 PROTEIN)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		4 / 6 GLY A  20
VAL A 256
HIS A 218
SER A 258
 None
 1.04A 3tj7C-3wqoA:
undetectable
3tj7D-3wqoA:
undetectable		 3tj7C-3wqoA:
20.53
3tj7D-3wqoA:
20.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3TJ7_D_ACTD605_0
(GBAA_1210 PROTEIN)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		4 / 6 VAL A 256
HIS A 218
SER A 258
GLY A  20
 None
 1.05A 3tj7C-3wqoA:
undetectable
3tj7D-3wqoA:
undetectable		 3tj7C-3wqoA:
20.53
3tj7D-3wqoA:
20.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3UY4_A_PAUA302_0
(PANTOTHENATE
SYNTHETASE)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		4 / 8 HIS A  78
VAL A 117
VAL A 115
ASP A 192
 MN  A1002 (-3.6A)
None
None
MN  A1001 ( 4.5A)
 1.17A 3uy4A-3wqoA:
undetectable		 3uy4A-3wqoA:
25.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4P6S_A_DAHA305_1
(TYROSINASE)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		5 / 7 HIS A  78
HIS A 220
HIS A 195
ASN A 160
VAL A 117
 MN  A1002 (-3.6A)
None
MN  A1001 (-3.5A)
None
None
 1.16A 4p6sA-3wqoA:
undetectable		 4p6sA-3wqoA:
21.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4P6S_B_DAHB305_1
(TYROSINASE)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		4 / 7 HIS A  78
HIS A 220
ASN A 160
VAL A 117
 MN  A1002 (-3.6A)
None
None
None
 0.94A 4p6sB-3wqoA:
undetectable		 4p6sB-3wqoA:
21.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4QB9_D_PARD500_1
(ENHANCED
INTRACELLULAR
SURVIVAL PROTEIN)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		4 / 8 PHE A  43
SER A 270
GLU A 159
ASP A 192
 None
None
MN  A1002 (-2.4A)
MN  A1001 ( 4.5A)
 0.99A 4qb9D-3wqoA:
undetectable		 4qb9D-3wqoA:
20.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5E72_A_SAMA400_0
(N2,
N2-DIMETHYLGUANOSINE
TRNA
METHYLTRANSFERASE)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		6 / 12 ILE A 251
PHE A 205
GLY A 215
ILE A 212
ILE A 193
ALA A 196
 None
 1.25A 5e72A-3wqoA:
undetectable		 5e72A-3wqoA:
22.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EWU_A_BEZA1401_0
(MAGNESIUM-CHELATASE
SUBUNIT CHLH,
CHLOROPLASTIC)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		4 / 6 GLY A 157
THR A 190
VAL A 115
HIS A  78
 None
None
None
MN  A1002 (-3.6A)
 0.94A 5ewuA-3wqoA:
undetectable		 5ewuA-3wqoA:
23.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5I3A_A_HQEA303_1
(TYROSINASE)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		5 / 7 HIS A  78
HIS A 220
HIS A 195
ASN A 160
VAL A 117
 MN  A1002 (-3.6A)
None
MN  A1001 (-3.5A)
None
None
 1.15A 5i3aA-3wqoA:
undetectable		 5i3aA-3wqoA:
21.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5I3A_B_HQEB304_1
(TYROSINASE)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		5 / 7 HIS A  78
HIS A 220
HIS A 195
ASN A 160
VAL A 117
 MN  A1002 (-3.6A)
None
MN  A1001 (-3.5A)
None
None
 1.18A 5i3aB-3wqoA:
undetectable		 5i3aB-3wqoA:
21.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5I3B_A_HQEA303_1
(TYROSINASE)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		5 / 7 HIS A  78
HIS A 220
HIS A 195
ASN A 160
VAL A 117
 MN  A1002 (-3.6A)
None
MN  A1001 (-3.5A)
None
None
 1.13A 5i3bA-3wqoA:
undetectable		 5i3bA-3wqoA:
21.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5M8R_A_MMSA511_1
(5,6-DIHYDROXYINDOLE-
2-CARBOXYLIC ACID
OXIDASE)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		4 / 7 HIS A 195
HIS A 222
ASN A 224
HIS A 231
 MN  A1001 (-3.5A)
MN  A1001 ( 4.9A)
None
MN  A1001 (-3.6A)
 1.02A 5m8rA-3wqoA:
undetectable		 5m8rA-3wqoA:
20.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5N0S_A_SAMA501_0
(PEPTIDE
N-METHYLTRANSFERASE)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		5 / 12 ILE A 156
GLY A 157
HIS A 218
ILE A 148
ALA A 149
 None
 0.92A 5n0sA-3wqoA:
undetectable		 5n0sA-3wqoA:
20.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5N0T_A_SAMA501_0
(PEPTIDE
N-METHYLTRANSFERASE)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		5 / 12 ILE A 156
GLY A 157
HIS A 218
ILE A 148
ALA A 149
 None
 1.00A 5n0tA-3wqoA:
undetectable		 5n0tA-3wqoA:
20.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5N0T_B_SAMB501_0
(PEPTIDE
N-METHYLTRANSFERASE)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		5 / 12 ILE A 156
GLY A 157
HIS A 218
ILE A 148
ALA A 149
 None
 1.00A 5n0tB-3wqoA:
undetectable		 5n0tB-3wqoA:
20.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5N0W_B_SAMB501_0
(PEPTIDE
N-METHYLTRANSFERASE)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		5 / 12 ILE A 156
GLY A 157
HIS A 218
ILE A 148
ALA A 149
 None
 0.95A 5n0wB-3wqoA:
undetectable		 5n0wB-3wqoA:
20.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5N0X_A_SAMA501_0
(PEPTIDE
N-METHYLTRANSFERASE)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		5 / 12 ILE A 156
GLY A 157
HIS A 218
ILE A 148
ALA A 149
 None
 0.98A 5n0xA-3wqoA:
undetectable		 5n0xA-3wqoA:
20.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5N4I_A_SAMA501_0
(PEPTIDE
N-METHYLTRANSFERASE)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		5 / 12 ILE A 156
GLY A 157
HIS A 218
ILE A 148
ALA A 149
 None
 0.93A 5n4iA-3wqoA:
undetectable		 5n4iA-3wqoA:
20.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5NCD_A_ACTA301_0
(PEPTIDOGLYCAN
N-ACETYLGLUCOSAMINE
DEACETYLASE)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		4 / 6 ASP A 229
HIS A 231
HIS A 195
HIS A 119
 MN  A1001 (-2.4A)
MN  A1001 (-3.6A)
MN  A1001 (-3.5A)
MN  A1002 (-3.4A)
 0.92A 5ncdA-3wqoA:
6.1
5ncdD-3wqoA:
5.2		 5ncdA-3wqoA:
23.42
5ncdD-3wqoA:
23.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5OEX_A_CUA601_0
(THIOCYANATE
DEHYDROGENASE)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		3 / 3 HIS A 195
ASP A 229
HIS A 231
 MN  A1001 (-3.5A)
MN  A1001 (-2.4A)
MN  A1001 (-3.6A)
 0.60A 5oexA-3wqoA:
undetectable		 5oexA-3wqoA:
21.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5OEX_A_CUA601_0
(THIOCYANATE
DEHYDROGENASE)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		3 / 3 HIS A 222
ASP A 192
HIS A 195
 MN  A1001 ( 4.9A)
MN  A1001 ( 4.5A)
MN  A1001 (-3.5A)
 0.78A 5oexA-3wqoA:
undetectable		 5oexA-3wqoA:
21.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5OEX_B_CUB601_0
(THIOCYANATE
DEHYDROGENASE)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		3 / 3 HIS A 195
ASP A 229
HIS A 231
 MN  A1001 (-3.5A)
MN  A1001 (-2.4A)
MN  A1001 (-3.6A)
 0.59A 5oexB-3wqoA:
undetectable		 5oexB-3wqoA:
21.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5OEX_C_CUC601_0
(THIOCYANATE
DEHYDROGENASE)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		3 / 3 HIS A 195
ASP A 229
HIS A 231
 MN  A1001 (-3.5A)
MN  A1001 (-2.4A)
MN  A1001 (-3.6A)
 0.56A 5oexC-3wqoA:
undetectable		 5oexC-3wqoA:
21.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5OEX_D_CUD601_0
(THIOCYANATE
DEHYDROGENASE)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		3 / 3 HIS A 195
ASP A 229
HIS A 231
 MN  A1001 (-3.5A)
MN  A1001 (-2.4A)
MN  A1001 (-3.6A)
 0.55A 5oexD-3wqoA:
undetectable		 5oexD-3wqoA:
21.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5TUI_B_CTCB405_0
(TETRACYCLINE
DESTRUCTASE TET(50))		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		5 / 12 GLU A 159
LEU A 187
GLY A 215
PRO A 172
GLY A 169
 MN  A1002 (-2.4A)
None
None
None
None
 1.13A 5tuiB-3wqoA:
undetectable		 5tuiB-3wqoA:
23.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6DH6_A_017A104_0
(PROTEASE)		 3wqo UNCHARACTERIZED
PROTEIN MJ1311
(Methanocaldococc
us
jannaschii) 		5 / 12 LEU A 187
ALA A 149
VAL A 116
VAL A  98
ILE A 156
 None
 0.89A 6dh6A-3wqoA:
undetectable		 6dh6A-3wqoA:
13.03